4-[5-phenyl-3-(trifluoromethyl)-1,2,4-triazol-1-yl]benzenesulfonic acid

Systemtic Name: 4-[5-phenyl-3-(trifluoromethyl)-1,2,4-triazol-1-yl]benzenesulfonic acid Openeye Name: 4-[5-phenyl-3-(trifluoromethyl)-1,2,4-triazol-1-yl]benzenesulfonic acid CAS Name: 4-[5-phenyl-3-(trifluoromethyl)-1,2,4-triazol-1-yl]benzenesulfonic acid IUPAC Name: 4-[5-phenyl-3-(trifluoromethyl)-1,2,4-triazol-1-yl]benzenesulfonic acid Traditional Name: 4-[5-phenyl-3-(trifluoromethyl)-1,2,4-triazol-1-yl]besylic acid Formula: C15H10F3N3O3S MolecularWeight: 369.31841

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NN2C3=CC=C(C=C3)S(=O)(=O)O)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NN2C3=CC=C(C=C3)S(=O)(=O)O)C(F)(F)F

InChI

InChI=1S/C15H10F3N3O3S/c16-15(17,18)14-19-13(10-4-2-1-3-5-10)21(20-14)11-6-8-12(9-7-11)25(22,23)24/h1-9H,(H,22,23,24)